N,N-bis(diphenylphosphanyl)butan-1-amine; chloranylruthenium(1+); cyclopentane; triphenylphosphane

Systemtic Name: N,N-bis(diphenylphosphanyl)butan-1-amine; chloranylruthenium(1+); cyclopentane; triphenylphosphane Openeye Name: N,N-bis(diphenylphosphanyl)butan-1-amine; chlororuthenium(1+); cyclopentane; triphenylphosphane CAS Name: N,N-bis(diphenylphosphino)-1-butanamine; chlororuthenium(1+); cyclopentane; triphenylphosphine IUPAC Name: N,N-bis(diphenylphosphanyl)butan-1-amine; chlororuthenium(1+); cyclopentane; triphenylphosphane Traditional Name: butyl-bis(diphenylphosphino)amine; chlororuthenium(1+); cyclopentane; triphenylphosphine Formula: C51H49ClNP3Ru+ MolecularWeight: 905.385743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.Cl[Ru+]

Isomeric SMILES

CCCCN(P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.Cl[Ru+]

InChI

InChI=1S/C28H29NP2.C18H15P.C5H5.ClH.Ru/c1-2-3-24-29(30(25-16-8-4-9-17-25)26-18-10-5-11-19-26)31(27-20-12-6-13-21-27)28-22-14-7-15-23-28;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;;/h4-23H,2-3,24H2,1H3;1-15H;1-5H;1H;/q;;;;+2/p-1